0 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1289 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.125 CC1=CC=CC=C1NCC(=O)O BB12-2586 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.125 CC1=CC=CC=C1OCC(=O)O BB01-6379 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 BB12-2037 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [1,0,0,0,0,0|1,0,1]=3 6 B13R1.90 CCC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1346 [0,1,0,0,0,0|1,0,0]=2 7 B13R1.150 CC1=CC=CC(\C=C\C(=O)O)=C1C BB56-1349 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.164 CC1=CC(Br)=C(\C=C\C(=O)O)C=C1 BB56-1347 [0,1,0,0,0,0|1,0,0]=2 9 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Br BB56-0119 [0,1,0,0,0,0|1,0,2]=4 10 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O BB12-2908 [0,1,0,0,0,0|1,0,2]=4 11 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1O BB12-3041 [0,1,0,0,0,0|1,0,0]=2 12 B13R1.893 O=C(O)\C=C\C1=CC(Br)=CC=C1F BB56-1288 [0,1,0,0,0,0|1,0,0]=2 13 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 BB12-3811 [0,0,0,1,0,0|2,0,0]=3 14 B13R2.435 CC(=O)C1=CN2C=CC=CC2=C1 BB12-3461 [0,0,0,1,0,0|3,0,0]=4 15 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 BB12-2951 [0,0,0,1,0,0|2,0,0]=3 16 B13R2.435 O=C(O)C1=NC2=CC=CC=C2O1 BB12-1678 [0,0,0,1,0,0|1,0,0]=2 17 B13R2.435 O=C(O)C1=NC2=CC=CN=C2N1 BB12-3038 [0,0,0,1,0,0|3,0,0]=4 18 B13R2.435 OB(O)C1=CC2=CC=CC=C2S1 BB56-0658 [0,0,0,1,0,0|1,1,1]=4 19 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 BB17-0572 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [0,0,0,0,1,0|2,1,0]=4 21 B10R1.17 NC\C=C\C1=CC=CC=C1 BB12-1612 [2,0,0,0,0,0|1,0,1]=4 22 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 BB12-2588 [1,1,0,0,0,0|1,0,1]=4 23 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 BB12-1847 [1,1,0,0,0,0|1,0,1]=4 24 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 BB17-2516 [1,1,0,0,0,0|0,0,0]=2 25 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [1,1,0,0,0,0|1,0,1]=4 26 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 BB12-1278 [1,1,0,0,0,0|1,0,1]=4 27 B12R1.226 CC1=CC(NCC(=O)O)=CC=C1 BB12-2587 [1,1,0,0,0,0|1,0,1]=4 28 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 BB12-2907 [1,1,0,0,0,0|0,0,2]=4 29 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BB17-0708 [1,1,0,0,0,0|0,0,0]=2 30 B12R1.226 O=C(O)\C=C\C1=CC(I)=CC=C1 BB56-2320 [1,1,0,0,0,0|0,0,0]=2 31 B12R1.75 COC1=C(CC(=O)Cl)C=CC=C1 BB20-1618 [0,1,0,0,1,0|1,0,1]=4 32 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 BB12-5051 [0,1,0,0,1,0|2,0,0]=4 33 B12R1.124 CC1=CC=CC=C1C(N)C(=O)O BB56-0340 [0,1,0,0,1,0|1,0,1]=4 34 B12R1.124 NC(C(=O)O)C1=C(Cl)C=CC=C1 BB56-0238 [0,1,0,0,1,0|1,0,1]=4 35 B12R1.124 NC(C(=O)O)C1=CC=CC=C1F BB56-0262 [0,1,0,0,1,0|1,0,1]=4 36 B12R1.127 CC(=O)NC1=CC(N)=CC=C1O BB17-2624 [0,1,0,0,1,0|2,0,0]=4 37 B12R1.127 CC1=CC=C(C)C(CC(=O)O)=C1 BB56-0458 [0,1,0,0,1,0|1,0,1]=4 38 B12R1.127 CC1=CC=C(Cl)C(CC(=O)O)=C1 BB56-1010 [0,1,0,0,1,0|1,0,1]=4 39 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O BB12-2649 [0,1,0,0,1,0|2,0,0]=4 40 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F BB56-2547 [0,1,0,0,1,0|1,0,1]=4 41 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Cl BB56-2649 [0,1,0,0,1,0|1,0,1]=4 42 B14R1.1865 COC1=C(\C=C\C(=O)O)C=C(Cl)C=C1 BB12-4676 [0,2,0,0,0,0|0,0,0]=2 43 B14R1.4522 O=C(O)CSC1=C(C(=O)O)C=CC=C1 BB12-1323 [0,2,0,0,0,0|1,0,1]=4 44 B12R2.24 FC1=CC2=CC=CC=C2C=C1 BB53-1916 [1,0,0,1,0,0|2,0,0]=4 45 B12R2.1081 BrC1=C2C=CC=NC2=CC=C1 BB56-0626 [1,0,0,1,0,0|2,0,0]=4 46 B12R2.1081 OC1=CC=NC2=CC=CC=C12 BB01-2824 [1,0,0,1,0,0|2,0,0]=4 47 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 BB56-1783 [0,0,0,1,1,0|2,0,0]=4 48 B14R2.768 O=C(O)CN1C=C2C=CC=CC2=N1 BB12-3277 [0,0,0,1,0,1|1,0,1]=4 49 B14R2.2 O=C(O)CC1=CNC2=CC=CC=C12 BB56-1705 [0,1,0,1,0,0|1,0,1]=4 50 B14R2.450 CC(=O)C1=C(N)C2=CC=CN=C2O1 BB20-3090 [0,1,0,1,0,0|2,0,0]=4 51 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2N1 BB12-2295 [0,1,0,1,0,0|1,0,0]=3 52 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 BB56-0399 [0,1,0,1,0,0|1,0,0]=3 53 B14R2.7969 CC1=CC=CC2=NC(C(=O)O)=CN12 BB26-0256 [0,1,0,1,0,0|2,0,0]=4 54 B14R2.7969 CC1=CC=CN2C=C(C(=O)O)N=C12 BB56-1827 [0,1,0,1,0,0|2,0,0]=4 55 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2N1 BB56-0695 [0,1,0,1,0,0|1,0,0]=3 56 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)S1 BB26-0840 [0,1,0,1,0,0|0,1,0]=3 57 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 BB56-1354 [0,1,0,1,0,0|1,0,0]=3 58 B14R2.4529 CC1=CC2=C(C=C1)N=C(C(=O)O)N2 BB12-2742 [0,1,0,1,0,0|2,0,0]=4 59 B14R2.4529 CC1=CC2=NC(C(=O)O)=CN2C=C1 BB26-0255 [0,1,0,1,0,0|2,0,0]=4 60 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 BB56-1149 [0,1,0,1,0,0|1,0,0]=3 61 B14R2.4529 CC1=CC=C2NC(C(=O)O)=CC2=C1 BB01-5002 [0,1,0,1,0,0|1,0,0]=3 62 B14R2.4529 CC1=CN2C=C(C(=O)O)N=C2C=C1 BB12-2943 [0,1,0,1,0,0|2,0,0]=4 63 B14R2.4529 NC1=CC=C2SC(C(=O)[O-])=CC2=C1 BB56-1828 [0,1,0,1,0,0|0,1,1]=4 64 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 BB20-4570 [0,1,0,1,0,0|1,0,0]=3 65 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2N1 BB56-0738 [0,1,0,1,0,0|1,0,0]=3 66 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 BB56-0739 [0,1,0,1,0,0|1,0,0]=3 67 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2S1 BB56-1661 [0,1,0,1,0,0|0,1,0]=3 68 B14R2.4529 O=C(O)C1=CC2=CC=C(I)C=C2N1 BB56-1734 [0,1,0,1,0,0|1,0,0]=3 69 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=N1 BB56-1825 [0,1,0,1,0,0|2,0,0]=4 70 B14R2.4529 O=C([O-])C1=CC2=CC=C(Cl)C=C2S1 BB56-1728 [0,1,0,1,0,0|0,1,1]=4 71 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 BB11-0045 [0,1,0,1,0,0|2,0,0]=4 72 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2O1 BB12-4600 [0,1,0,1,0,0|1,0,0]=3 73 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [1,0,0,0,1,0|2,0,0]=4 74 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [0,0,0,0,2,0|2,0,0]=4